4-ethyl-1-methoxy-3,7-dimethylpyrrolo[1,2-a]pyrazine

C12H16N2O — CID 21350123

IUPAC4-ethyl-1-methoxy-3,7-dimethylpyrrolo[1,2-a]pyrazine
SMILESCCc1c(C)nc(OC)c2cc(C)cn12
InChIInChI=1S/C12H16N2O/c1-5-10-9(3)13-12(15-4)11-6-8(2)7-14(10)11/h6-7H,5H2,1-4H3
InChIKeySVGYQMJZEIWJIE-UHFFFAOYSA-N
MW204.27 g/mol
LogP2.52
Rot. Bonds2

About 4-ethyl-1-methoxy-3,7-dimethylpyrrolo[1,2-a]pyrazine

4-ethyl-1-methoxy-3,7-dimethylpyrrolo[1,2-a]pyrazine (PubChem CID 21350123) has the molecular formula C12H16N2O and a molecular weight of 204.27 g/mol. Its IUPAC name is 4-ethyl-1-methoxy-3,7-dimethylpyrrolo[1,2-a]pyrazine.

Molecular Properties

Compound Name4-ethyl-1-methoxy-3,7-dimethylpyrrolo[1,2-a]pyrazine
PubChem CID21350123
Molecular FormulaC12H16N2O
Molecular Weight204.27 g/mol
Exact Mass204.13
IUPAC Name4-ethyl-1-methoxy-3,7-dimethylpyrrolo[1,2-a]pyrazine
SMILESCCc1c(C)nc(OC)c2cc(C)cn12
InChIInChI=1S/C12H16N2O/c1-5-10-9(3)13-12(15-4)11-6-8(2)7-14(10)11/h6-7H,5H2,1-4H3
InChIKeySVGYQMJZEIWJIE-UHFFFAOYSA-N
XLogP2.52
TPSA26.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.27
LogP ≤ 52.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-methoxy-5-(2-methyl-5-phenyl-1H-pyrrol-1-yl)pyridine
CID 742245
7-[(4-Fluorophenyl)methoxy]-2,3-dimethyl-1-(2-methylpropyl)pyrrolo[2,3-c]pyridine
CID 11558912
7-[(4-Fluorophenyl)methoxy]-2,3-dimethyl-1-propylpyrrolo[2,3-c]pyridine
CID 11616595
7-[(4-Fluorophenyl)methoxy]-2,3-dimethyl-1-prop-2-enylpyrrolo[2,3-c]pyridine
CID 11659585
1-(Cyclopropylmethyl)-7-[(4-fluorophenyl)methoxy]-2,3-dimethylpyrrolo[2,3-c]pyridine
CID 49864417
7-Methoxy-6-azaindole
CID 11029988
9-methoxy-4-[(1E,3E)-penta-1,3-dienyl]pyrrolo[1,2-a]quinoxaline
CID 90675548
4-[(1E,3E)-hepta-1,3-dienyl]-9-methoxy-pyrrolo[1,2-a]quinoxaline
CID 90675552
9-methoxy-4-[(1E,3E)-octa-1,3-dienyl]pyrrolo[1,2-a]quinoxaline
CID 90675556
5-Methoxy-2-methyl-1H-pyrrolo(2,3-c)pyridine
CID 55283243
5-methoxy-1-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrrolo[2,3-c]pyridine
CID 56973268
6-Bromo-1-methoxypyrrolo(1,2-a)pyrazine
CID 158964785

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-1-methoxy-3,7-dimethylpyrrolo[1,2-a]pyrazine?
The IUPAC name of 4-ethyl-1-methoxy-3,7-dimethylpyrrolo[1,2-a]pyrazine (CID 21350123) is 4-ethyl-1-methoxy-3,7-dimethylpyrrolo[1,2-a]pyrazine.
What is the SMILES notation for 4-ethyl-1-methoxy-3,7-dimethylpyrrolo[1,2-a]pyrazine?
The canonical SMILES for 4-ethyl-1-methoxy-3,7-dimethylpyrrolo[1,2-a]pyrazine is CCc1c(C)nc(OC)c2cc(C)cn12.
What is the InChIKey of 4-ethyl-1-methoxy-3,7-dimethylpyrrolo[1,2-a]pyrazine?
The InChIKey is SVGYQMJZEIWJIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O/c1-5-10-9(3)13-12(15-4)11-6-8(2)7-14(10)11/h6-7H,5H2,1-4H3.
What are the key properties of 4-ethyl-1-methoxy-3,7-dimethylpyrrolo[1,2-a]pyrazine?
4-ethyl-1-methoxy-3,7-dimethylpyrrolo[1,2-a]pyrazine has a molecular weight of 204.27 g/mol, XLogP of 2.52, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-1-methoxy-3,7-dimethylpyrrolo[1,2-a]pyrazine is sourced from PubChem (CID 21350123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).